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Pallavi-Banerjee21 / votca

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Give error if no atoms of specified exist in IBI #77

Closed GoogleCodeExporter closed 9 years ago

GoogleCodeExporter commented 9 years ago 
csg_stat uses atom types, g_rdf index groups. If using csg_stat this might lead 
to problems. IBI should stop with error that no atoms of specified type exist.

Original issue reported on code.google.com by victor.r...@gmail.com on 25 Feb 2011 at 8:18

GoogleCodeExporter commented 9 years ago

Original comment by victor.r...@gmail.com on 25 Feb 2011 at 8:20

GoogleCodeExporter commented 9 years ago 
calc_rdf_gromacs.sh should only use type1, type2 as failback

Original comment by junghans%votca.org@gtempaccount.com on 27 Feb 2011 at 10:16

GoogleCodeExporter commented 9 years ago 
This issue was closed by revision b0797a4571.

Original comment by ruehle%v...@gtempaccount.com on 28 Feb 2011 at 11:32

GoogleCodeExporter commented 9 years ago 
calc_rdf_gromacs.sh still needs to be fixed....

Original comment by christop...@gmail.com on 28 Feb 2011 at 4:31

GoogleCodeExporter commented 9 years ago 
This issue was closed by revision 28a5c85f19.

Original comment by junghans%votca.org@gtempaccount.com on 1 Mar 2011 at 2:29